Ammonium → 1-ethyl-5-(2-methanesulfonylethyl)-1H-pyrazole-3-carbonitrile
반응식
[CH2:1]([CH3:2])[n:3]1[n:4][c:5]([C:14](=[O:15])[NH2:16])[cH:6][c:7]1[CH2:8][CH2:9][S:10](=[O:11])(=[O:12])[CH3:13].[NH4+:17].[OH-:18].[P:19]([Cl:20])([Cl:21])([Cl:22])=[O:23]>>[CH2:1]([CH3:2])[n:3]1[n:4][c:5]([C:14]#[N:16])[cH:6][c:7]1[CH2:8][CH2:9][S:10](=[O:11])(=[O:12])[CH3:13]참가 물질
5
출처 및 근거
- ORD 기록
- ord-befcb300624e47ddadf4b61d7808c5b4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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